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Prost-13-en-1-oic acid, 9,11-dihydroxy-, (9.alpha.,11.alpha.,13E)-
SpectraBase Compound ID 6k6xwoWr9n9
InChI InChI=1S/C20H36O4/c1-2-3-4-5-6-9-12-16-17(19(22)15-18(16)21)13-10-7-8-11-14-20(23)24/h9,12,16-19,21-22H,2-8,10-11,13-15H2,1H3,(H,23,24)/b12-9+/t16-,17-,18-,19+/m1/s1
InChIKey YPJFKNVBZIRKPQ-QCVRHGSASA-N
Mol Weight 340.5 g/mol
Molecular Formula C20H36O4
Exact Mass 340.26136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J6zb8x4aGcY
Name Prost-13-en-1-oic acid, 9,11-dihydroxy-, (9.alpha.,11.alpha.,13E)-
Alternate Name(s) (9beta,11beta,13E)-9,11-dihydroxyprost-13-en-1-oic acid r-1-hydroxy-2-t-(6'-carboxyhexyl)-3-t-(1'-e-octenyl)-4-c-hydroxycyclopentane
CAS Registry Number 52554-15-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H36O4
InChI InChI=1S/C20H36O4/c1-2-3-4-5-6-9-12-16-17(19(22)15-18(16)21)13-10-7-8-11-14-20(23)24/h9,12,16-19,21-22H,2-8,10-11,13-15H2,1H3,(H,23,24)/b12-9+/t16-,17-,18-,19+/m1/s1
InChIKey YPJFKNVBZIRKPQ-QCVRHGSASA-N
Molecular Weight 340.504 g/mol
SMILES O[C@]1(C[C@]([C@@]([C@]1(CCCCCCC(=O)O)[H])(\C=C\CCCCCC)[H])(O)[H])[H]
SPLASH splash10-002r-0091000000-d09ccac639851f79cc75
Source of Spectrum AN-85-516-0
Wiley ID 1335345